3-[2-(cyanomethyl)pyrrol-1-yl]propyl methanesulfonate

Systemtic Name: 3-[2-(cyanomethyl)pyrrol-1-yl]propyl methanesulfonate Openeye Name: 3-[2-(cyanomethyl)pyrrol-1-yl]propyl methanesulfonate CAS Name: methanesulfonic acid 3-[2-(cyanomethyl)-1-pyrrolyl]propyl ester IUPAC Name: 3-[2-(cyanomethyl)pyrrol-1-yl]propyl methanesulfonate Traditional Name: methanesulfonic acid 3-[2-(cyanomethyl)pyrrol-1-yl]propyl ester Formula: C10H14N2O3S MolecularWeight: 242.29476

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCN1C=CC=C1CC#N

Isomeric SMILES

CS(=O)(=O)OCCCN1C=CC=C1CC#N

InChI

InChI=1S/C10H14N2O3S/c1-16(13,14)15-9-3-8-12-7-2-4-10(12)5-6-11/h2,4,7H,3,5,8-9H2,1H3